==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER COMPLEX (SIGNAL TRANSDUCTION/PEPTIDE) 23-DEC-96 4GBQ . COMPND 2 MOLECULE: GRB2; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR M.WITTEKIND,C.MAPELLI,V.LEE,V.GOLDFARB,M.S.FRIEDRICHS, . 67 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4736.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 34 50.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 31.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 5 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 105 0, 0.0 26,-1.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 174.4 8.4 2.5 3.9 2 2 A E E -AB 26 56A 83 54,-1.2 54,-2.3 24,-0.2 2,-0.3 -0.815 360.0-168.9-115.2 153.1 7.7 0.5 0.7 3 3 A A E -AB 25 55A 0 22,-1.2 22,-1.4 -2,-0.3 2,-0.4 -0.925 6.8-153.8-137.9 156.0 4.6 -1.3 -0.4 4 4 A I E -AB 24 54A 33 50,-1.6 50,-1.6 -2,-0.3 2,-0.4 -0.957 17.2-131.5-143.7 116.4 3.8 -3.7 -3.2 5 5 A A E - B 0 53A 0 18,-2.5 17,-0.3 -2,-0.4 48,-0.3 -0.538 23.0-179.3 -68.3 125.9 0.5 -4.3 -4.8 6 6 A K + 0 0 71 46,-2.8 2,-0.3 -2,-0.4 47,-0.2 0.665 66.1 18.7 -97.4 -26.0 -0.1 -8.1 -5.0 7 7 A Y S S- 0 0 92 45,-1.3 15,-0.2 13,-0.1 -1,-0.1 -0.902 93.4 -80.6-142.1 168.3 -3.5 -8.0 -6.8 8 8 A D - 0 0 102 -2,-0.3 2,-0.3 12,-0.2 12,-0.2 -0.367 46.0-166.8 -69.0 145.4 -5.6 -5.6 -8.9 9 9 A F B -F 19 0B 11 10,-1.4 10,-2.3 -2,-0.0 2,-0.5 -0.938 17.2-175.1-147.0 128.9 -7.6 -3.0 -6.9 10 10 A K - 0 0 163 -2,-0.3 8,-0.1 8,-0.2 10,-0.0 -0.961 35.6-115.8-120.5 112.9 -10.4 -0.7 -7.9 11 11 A A - 0 0 39 -2,-0.5 3,-0.1 1,-0.1 7,-0.1 0.182 16.1-160.0 -47.8 158.9 -11.5 1.8 -5.2 12 12 A T + 0 0 93 1,-0.2 2,-0.3 5,-0.1 -1,-0.1 0.572 68.7 13.4-114.3 -22.5 -14.9 1.8 -3.5 13 13 A A S > S- 0 0 36 1,-0.0 3,-1.7 0, 0.0 -1,-0.2 -0.942 82.0 -88.7-154.0 173.1 -14.9 5.3 -2.2 14 14 A D T 3 S+ 0 0 153 -2,-0.3 -3,-0.0 1,-0.3 -1,-0.0 0.705 119.5 54.8 -55.0 -31.3 -13.5 8.8 -2.0 15 15 A D T 3 S+ 0 0 68 31,-0.1 32,-2.6 2,-0.0 2,-0.3 0.544 103.0 69.8 -88.9 -2.7 -11.0 8.0 0.7 16 16 A E B < -c 47 0A 8 -3,-1.7 2,-0.3 30,-0.3 32,-0.2 -0.757 65.1-156.5-112.9 156.6 -9.6 5.0 -1.3 17 17 A L - 0 0 10 30,-1.5 29,-0.1 -2,-0.3 -5,-0.1 -0.952 16.8-116.2-135.0 152.4 -7.4 5.0 -4.4 18 18 A S + 0 0 48 -2,-0.3 2,-0.3 -8,-0.1 -8,-0.2 -0.221 28.9 166.8 -82.2 170.9 -6.8 2.4 -7.1 19 19 A F B -F 9 0B 2 -10,-2.3 -10,-1.4 -2,-0.1 2,-0.3 -0.895 27.0-122.8-163.8-176.6 -3.9 0.5 -8.3 20 20 A K > - 0 0 113 -2,-0.3 3,-2.5 -12,-0.2 2,-0.3 -0.979 50.2 -76.0-140.3 144.5 -3.1 -2.5 -10.5 21 21 A R T 3 S+ 0 0 151 -2,-0.3 -15,-0.2 1,-0.2 -13,-0.2 -0.196 122.2 31.7 -46.9 102.2 -1.2 -5.7 -9.5 22 22 A G T 3 S+ 0 0 42 -17,-0.3 -1,-0.2 1,-0.3 -16,-0.1 0.094 77.8 144.5 136.3 -24.0 2.4 -4.5 -9.4 23 23 A D < - 0 0 39 -3,-2.5 -18,-2.5 -19,-0.1 2,-0.6 -0.114 46.0-135.1 -50.5 142.5 2.3 -0.8 -8.3 24 24 A I E -A 4 0A 106 -20,-0.2 2,-0.3 -22,-0.0 -20,-0.2 -0.894 31.4-159.5 -99.0 116.7 5.1 0.5 -6.1 25 25 A L E -A 3 0A 2 -22,-1.4 -22,-1.2 -2,-0.6 2,-0.7 -0.706 17.7-127.9-107.2 155.0 3.3 2.5 -3.3 26 26 A K E -AD 2 40A 124 14,-1.7 14,-1.7 -2,-0.3 2,-1.0 -0.861 21.3-145.8-101.6 110.9 4.5 5.2 -1.0 27 27 A V E + D 0 39A 13 -26,-1.6 12,-0.2 -2,-0.7 3,-0.1 -0.651 38.1 147.9 -87.4 107.0 3.7 4.3 2.6 28 28 A L + 0 0 120 10,-1.2 -1,-0.1 -2,-1.0 11,-0.1 0.757 58.2 19.7 -94.3 -99.2 2.9 7.6 4.4 29 29 A N + 0 0 89 8,-0.0 9,-1.2 2,-0.0 -1,-0.3 -0.267 55.1 175.6 -75.0 160.3 0.3 7.3 7.2 30 30 A E - 0 0 80 7,-0.2 7,-0.1 -3,-0.1 -3,-0.0 -0.648 17.2-162.6-168.9 105.3 -0.7 4.0 8.9 31 31 A E - 0 0 104 -2,-0.2 3,-0.1 1,-0.1 6,-0.1 -0.034 58.0 -98.4 -84.0 29.0 -3.2 4.2 11.8 32 32 A C + 0 0 108 1,-0.2 -1,-0.1 4,-0.1 2,-0.1 0.660 69.1 165.6 58.5 23.6 -2.1 0.7 12.9 33 33 A D - 0 0 14 3,-0.1 -1,-0.2 1,-0.1 2,-0.0 -0.391 37.0-142.8 -67.8 147.1 -5.2 -0.7 11.1 34 34 A Q S S+ 0 0 139 1,-0.2 -1,-0.1 -3,-0.1 3,-0.1 -0.302 96.0 33.0-108.3 44.9 -5.0 -4.5 10.6 35 35 A N S S+ 0 0 47 1,-0.4 15,-2.2 13,-0.1 16,-0.4 0.288 113.7 45.4-169.4 -18.1 -6.7 -4.4 7.2 36 36 A W E - E 0 49A 9 13,-0.3 -1,-0.4 14,-0.1 2,-0.3 -0.884 49.6-159.2-140.3 166.4 -5.6 -1.1 5.5 37 37 A Y E - E 0 48A 26 11,-1.9 11,-1.7 -2,-0.3 2,-0.6 -0.985 19.1-134.5-142.2 146.2 -2.7 1.3 4.6 38 38 A K E + E 0 47A 58 -9,-1.2 -10,-1.2 -2,-0.3 2,-0.3 -0.920 44.8 155.2-101.5 119.0 -2.6 5.0 3.6 39 39 A A E -DE 27 46A 1 7,-2.1 7,-1.9 -2,-0.6 2,-0.4 -0.863 40.4-105.5-141.3 172.1 -0.2 5.3 0.6 40 40 A E E +DE 26 45A 100 -14,-1.7 -14,-1.7 -2,-0.3 2,-0.3 -0.885 40.3 154.5-109.8 136.2 0.7 7.4 -2.4 41 41 A L E > - E 0 44A 13 3,-2.8 3,-1.9 -2,-0.4 -23,-0.1 -0.948 59.9 -8.9-160.1 136.0 -0.0 6.6 -6.0 42 42 A N T 3 S- 0 0 141 -2,-0.3 3,-0.1 1,-0.3 -24,-0.0 0.649 127.5 -48.3 57.3 21.5 -0.5 8.2 -9.3 43 43 A G T 3 S+ 0 0 82 1,-0.4 -1,-0.3 0, 0.0 2,-0.3 0.537 123.6 89.3 94.7 10.7 -0.8 11.7 -7.9 44 44 A K E < - E 0 41A 112 -3,-1.9 -3,-2.8 2,-0.0 -1,-0.4 -0.836 60.2-146.8-132.0 169.4 -3.2 10.7 -5.1 45 45 A D E + E 0 40A 83 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.997 37.7 121.0-141.5 129.8 -3.2 9.4 -1.6 46 46 A G E - E 0 39A 1 -7,-1.9 -7,-2.1 -2,-0.3 -30,-0.3 -0.985 56.0 -54.0-172.1-180.0 -5.7 7.0 -0.0 47 47 A F E +cE 16 38A 46 -32,-2.6 -30,-1.5 -2,-0.3 -9,-0.2 -0.423 41.8 177.9 -77.5 146.3 -6.6 3.8 1.6 48 48 A I E - E 0 37A 0 -11,-1.7 -11,-1.9 -32,-0.2 2,-0.2 -0.979 33.3-101.6-142.8 144.3 -5.6 0.4 0.2 49 49 A P E > - E 0 36A 0 0, 0.0 3,-0.9 0, 0.0 4,-0.4 -0.492 15.4-140.1 -79.2 145.8 -6.2 -3.1 1.7 50 50 A K G > S+ 0 0 81 -15,-2.2 3,-1.8 1,-0.3 -14,-0.1 0.904 102.1 55.2 -67.4 -44.2 -3.5 -5.1 3.5 51 51 A N G 3 S+ 0 0 63 -16,-0.4 -1,-0.3 1,-0.3 -15,-0.1 0.689 105.7 54.9 -67.4 -10.2 -4.5 -8.5 2.0 52 52 A Y G < S+ 0 0 20 -3,-0.9 -46,-2.8 8,-0.1 -45,-1.3 0.546 114.6 39.6 -93.6 -10.2 -4.1 -6.9 -1.5 53 53 A I E < -B 5 0A 11 -3,-1.8 2,-0.3 -4,-0.4 -48,-0.2 -0.770 66.5-138.8-131.1 175.1 -0.5 -5.7 -0.8 54 54 A E E -B 4 0A 93 -50,-1.6 -50,-1.6 -2,-0.2 2,-0.2 -0.990 22.7-131.8-135.7 133.8 2.8 -6.8 0.9 55 55 A M E -B 3 0A 63 -2,-0.3 -52,-0.2 -52,-0.2 -5,-0.0 -0.556 15.7-168.2 -85.9 158.7 5.0 -4.4 3.0 56 56 A K E B 2 0A 107 -54,-2.3 -54,-1.2 -2,-0.2 -2,-0.0 -0.756 360.0 360.0-152.8 95.1 8.8 -4.1 2.5 57 57 A P 0 0 149 0, 0.0 -54,-0.0 0, 0.0 0, 0.0 0.172 360.0 360.0 -63.1 360.0 10.9 -2.1 5.2 58 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 59 1 B V 0 0 182 0, 0.0 -52,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 116.6 -9.1 -14.6 -8.0 60 2 B P - 0 0 56 0, 0.0 3,-0.1 0, 0.0 -8,-0.1 -0.313 360.0 -85.5 -69.8 159.7 -8.0 -12.0 -5.4 61 3 B P - 0 0 32 0, 0.0 2,-0.4 0, 0.0 -9,-0.0 -0.029 47.1 -90.5 -55.8 159.7 -8.9 -12.1 -1.7 62 4 B P - 0 0 116 0, 0.0 -11,-0.1 0, 0.0 0, 0.0 -0.598 50.8-119.8 -72.1 127.3 -12.1 -10.7 -0.0 63 5 B V - 0 0 58 -2,-0.4 3,-0.0 1,-0.1 -28,-0.0 -0.349 29.8-104.5 -71.3 149.6 -11.4 -7.2 0.9 64 6 B P - 0 0 11 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.390 34.2 -98.6 -71.1 155.3 -11.6 -6.2 4.5 65 7 B P - 0 0 97 0, 0.0 3,-0.3 0, 0.0 2,-0.1 -0.589 47.4-126.9 -70.5 123.4 -14.5 -4.2 6.1 66 8 B R S S+ 0 0 132 -2,-0.4 -30,-0.0 1,-0.2 -3,-0.0 -0.388 86.3 39.4 -74.9 156.7 -13.2 -0.6 6.2 67 9 B R 0 0 227 -2,-0.1 -1,-0.2 0, 0.0 0, 0.0 0.847 360.0 360.0 72.1 43.3 -13.3 1.4 9.5 68 10 B R 0 0 158 -3,-0.3 -2,-0.1 -4,-0.0 -33,-0.0 0.908 360.0 360.0 59.9 360.0 -12.2 -1.6 11.7